SCHEMBL974865

SCHEMBL974865

O=C(Nc1ccc2ncnn2c1)c1cc2cc(F)ccc2n1Cc1cccc(F)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.44
ECE1 P42892 2/20 0.43
SCD O00767 13/20 0.42
SCD5 Q86SK9 9/20 0.42
TNIK Q9UKE5 1/20 0.42
MAOB P27338 1/20 0.42
CCR2 P41597 1/20 0.41
ABCB1 P08183 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL974021 0.83 ECE1 (0.49) F10ECE1SCDSCD5MAOB
SCHEMBL974450 0.83 MCHR1 (0.46) F10ECE1SCDSCD5MAOB
SCHEMBL973614 0.82 ECE1 (0.47) F10ECE1CCR2ABCB1
SCHEMBL977904 0.81 ECE1 (0.46) F10ECE1SCDSCD5MAOB
SCHEMBL974924 0.81 ECE1 (0.49) F10ECE1ABCB1
SCHEMBL976277 0.81 F10 (0.45) F10ECE1SCDSCD5MAOB
SCHEMBL974519 0.81 ECE1 (0.58) F10ECE1MAOBCCR2ABCB1
SCHEMBL2900723 0.81 ECE1 (0.58) F10ECE1SCDSCD5MAOB
SCHEMBL3148861 0.80 MAOB (0.50) F10ECE1MAOBCCR2ABCB1
SCHEMBL1094481 0.79 F10 (0.43) F10ECE1SCDSCD5MAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2235016-B1 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-09-18 EP claimed
US-8394820-B2 N-azabicyclic carboxamide derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-03-12 US claimed
US-20110009444-A1 N-AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-01-13 US claimed
EP-2235016-B1 AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2013-09-18 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110009444-A1 N-AZABICYCLIC CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF XDH, NQO2, SLC28A2 F10 2006/4885ECE1 3013/4885SCD 4662/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.